Product Name

  • Name

    2-Chloro-N-(4-sulfamoyl-phenyl)-acetamide

  • EINECS
  • CAS No. 14949-01-0
  • Article Data52
  • CAS DataBase
  • Density 1.527 g/cm3
  • Solubility
  • Melting Point 217 °C
  • Formula C8H9ClN2O3S
  • Boiling Point
  • Molecular Weight 248.69
  • Flash Point
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 14949-01-0 (2-Chloro-N-(4-sulfamoyl-phenyl)-acetamide)
  • Hazard Symbols
  • Synonyms Acetanilide,2-chloro-4'-sulfamoyl- (6CI,7CI,8CI);N-[4-(Aminosulfonyl)phenyl]-2-chloroacetamide;N4-Chloracetylsulfanilamide;NSC525660;2-Chloro-N-(4-sulfamoylphenyl)acetamide;AC1L704K;MolPort-000-225-321;CID352299;STK325976;ZINC00127420;2-Chloro-N-(sulfamoylphenyl)acetamide;AKOS000266814;
  • PSA 97.64000
  • LogP 2.36540

Acetamide,N-[4-(aminosulfonyl)phenyl]-2-chloro- Specification

The Acetamide,N-[4-(aminosulfonyl)phenyl]-2-chloro- with CAS registry number of 14949-01-0 is also known as N-[4-(Aminosulfonyl)phenyl]-2-chloroacetamide. The IUPAC name is 2-Chloro-N-(4-sulfamoylphenyl)acetamide. In addition, the formula is C8H9ClN2O3S and the molecular weight is 248.69.

Physical properties about this chemical are: (1)ACD/LogP: 0.55; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.55; (4)ACD/LogD (pH 7.4): 0.55; (5)ACD/BCF (pH 5.5): 1.53; (6)ACD/BCF (pH 7.4): 1.53; (7)ACD/KOC (pH 5.5): 47.25; (8)ACD/KOC (pH 7.4): 47.12; (9)#H bond acceptors: 5; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 66.07Å2; (13)Index of Refraction: 1.617; (14)Molar Refractivity: 57.04 cm3; (15)Molar Volume: 162.8 cm3; (16)Polarizability: 22.61×10-24cm3; (17)Surface Tension: 65.7 dyne/cm; (18)Density: 1.527 g/cm3.

Preparation of Acetamide,N-[4-(aminosulfonyl)phenyl]-2-chloro-: it is prepared by reaction of 4-Amino-benzenesulfonamide with Chloroacetyl chloride. The reaction needs reagent Dioxane benzene for 1 hour. The yield is about 80%.

Acetamide,N-[4-(aminosulfonyl)phenyl]-2-chloro- is prepared by reaction of 4-Amino-benzenesulfonamide with Chloroacetyl chloride.

Uses of Acetamide,N-[4-(aminosulfonyl)phenyl]-2-chloro-: it is used to produce 2-Benzylamino-benzoic acid (4-sulfamoyl-phenylcarbamoyl)-methyl ester. The reaction occurs with reagent Dimethylformamide and other condition of heating for 2 hours. The yield is 61%.

Acetamide,N-[4-(aminosulfonyl)phenyl]-2-chloro- is used to produce 2-Benzylamino-benzoic acid (4-sulfamoyl-phenylcarbamoyl)-methyl ester.

You can still convert the following datas into molecular structure:
1. SMILES: O=S(=O)(N)c1ccc(NC(=O)CCl)cc1
2. InChI: InChI=1/C8H9ClN2O3S/c9-5-8(12)11-6-1-3-7(4-2-6)15(10,13)14/h1-4H,5H2,(H,11,12)(H2,10,13,14)
3. InChIKey: WBDDNKFSVVIFOG-UHFFFAOYAT
4. Std. InChI: InChI=1S/C8H9ClN2O3S/c9-5-8(12)11-6-1-3-7(4-2-6)15(10,13)14/h1-4H,5H2,(H,11,12)(H2,10,13,14)
5. Std. InChIKey: WBDDNKFSVVIFOG-UHFFFAOYSA-N

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